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ethyl 2-amino-4-(4-tert-butylphenyl)thiophene-3-carboxylate

ethyl 2-amino-4-(4-tert-butylphenyl)thiophene-3-carboxylate

CAS: 307511-84-8

Formula: C17H21NO2S

SMILES: CCOC(=O)C1=C(N)SC=C1C1=CC=C(C=C1)C(C)(C)C

IUPAC: ethyl 2-amino-4-(4-tert-butylphenyl)thiophene-3-carboxylate

InChI: InChI=1S/C17H21NO2S/c1-5-20-16(19)14-13(10-21-15(14)18)11-6-8-12(9-7-11)17(2,3)4/h6-10H,5,18H2,1-4H3

Composition: C (67.30%), H (6.98%), N (4.62%), O (10.55%), S (10.57%)

Molar Mass: 303.42

Atom Count: 42

Heavy Atom Count: 21

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 303.129300094
Formal Charge 0
FSP3 0.35
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey CVICNZAIGJEBRL-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 87.6
Topological Polar Surface Area 52.32
Polarizability 34.63
Ring Count 2
Rotatable Bond Count 5

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Life Chemicals USA, Inc.
Purity LeadTime CAS PacketSize UnitPrice
95% <7 Days 307511-84-8 $123.75-$1,376.10$123.75$193.05$297.99$668.25$985.05$1,376.10
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MATRIX SCIENTIFIC
Purity LeadTime CAS PacketSize UnitPrice
95% <2 Days 307511-84-8 $134.76$134.76
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